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CS-W001157 4
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1-(1H-indol-3-yl)propan-1-one

  • CAS No. 22582-68-9

  • Cat. No. CS-0313637
  • Purity95+%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

1-(1H-indol-3-yl)propan-1-one|CS-0313637

Structure of 22582-68-9

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General Information

  • CAS No. 22582-68-9
  • Cat. No. CS-0313637
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁NO
  • Molecular Weight 173.21
  • Synonym(s) 1-(1H-INDOL-3-YL)-PROPAN-1-ONE
  • SMILES CCC(=O)C1=CNC2=CC=CC=C12

Synthesis

  • Route1
    • Indole, ≥99%|CS-1268948
      120-72-9
    • null|null
      79-03-8
    • ~81%
    • 1-(1H-indol-3-yl)propan-1-one|CS-0313637
      22582-68-9

    References

    • Okauchi; Itonaga; Minami; Owa; Kitoh; Yoshino Organic letters, 2000 , vol. 2, # 10 p. 1485 - 1487
  • Route2
    • Indole, ≥99%|CS-1268948
      120-72-9
    • null|null
      123-62-6
    • ~47%
    • 1-(1H-indol-3-yl)propan-1-one|CS-0313637
      22582-68-9

    References

    • Wynne, James H.; Lloyd, Christopher T.; Jensen, Samuel D.; Boson, Sean; Stalick, Wayne M. Synthesis, 2004 , # 14 p. 2277 - 2282
  • Route3

    References

    • Ketcha, Daniel M.; Gribble, Gordon W. Journal of Organic Chemistry, 1985 , vol. 50, # 26 p. 5451 - 5457

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   32.86
  • LogP   2.7606
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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